NIH-ZINC04003901 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 69 0 0 0 0 0 0 0 0999 V2000 0.8720 1.3630 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -0.0450 0.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.9090 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -2.2400 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -2.8350 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -4.0240 -0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -1.9130 -0.9430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -2.2650 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.5530 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 0.1250 -1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -2.7530 2.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -1.7100 3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5770 2.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -1.8180 4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -1.9550 6.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -1.8440 7.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -0.5660 6.6700 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -0.3140 5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -0.3720 4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3540 0.3590 7.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 -0.0450 8.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 0.8840 9.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5710 2.2480 9.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 2.6810 8.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 1.7470 7.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 2.2130 6.4050 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -4.1350 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -5.0020 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -6.4670 3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -7.3360 3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -7.6100 4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -8.4100 4.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -8.9370 2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -8.6640 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -7.8680 1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 1.4620 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 1.9090 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.7980 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -1.0100 5.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -2.7680 5.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -2.9570 6.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -1.2050 7.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 -1.9540 8.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 -2.6650 6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0720 0.6370 4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 -1.0920 4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 0.4200 5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.3020 3.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 -1.0990 8.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4170 0.5370 10.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0400 2.9670 9.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 3.7400 8.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -4.1480 3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -4.5130 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -4.9150 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -4.6320 3.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -6.5580 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -6.8410 2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -7.2100 5.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -8.6270 5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 -9.5640 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -9.0760 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -7.6680 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -1.7140 5.2630 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0290 -2.4510 4.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 64 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 64 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 64 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 33 34 2 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END